SCHEMBL2292893

SCHEMBL2292893

CC(C)(C)OC(=O)C(ON1C(=O)c2ccccc2C1=O)c1cccc(C#N)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.50
GRM5 P41594 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
KDM4D Q6B0I6 1/20 0.36
ADRA1D P25100 4/20 0.36
ADRA1A P35348 2/20 0.36
ADRA2B P18089 1/20 0.36
ADRA1B P35368 1/20 0.35
MGLL Q99685 3/20 0.35
GPR139 Q6DWJ6 1/20 0.35
NAMPT P43490 1/20 0.35
OPRM1 P35372 1/20 0.34
OPRK1 P41145 1/20 0.34
ABCB1 P08183 3/20 0.33
PDCD1 Q15116 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
KCNA5 P22460 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2294069 0.84 TNF (0.56) TNFGRM5MEN1KMT2AADRA1D
SCHEMBL10852201 0.84 CYP3A4 (0.40) TNFMEN1KMT2A
SCHEMBL2294348 0.76 TNF (0.47) TNFKMT2AMGLLPDCD1CD274
SCHEMBL2296620 0.75 GRM4 (0.43) TNFKDM4DADRA1DADRA1AADRA2B
SCHEMBL28550917 0.74 ADRA1D (0.40) TNFKDM4DADRA1DADRA1AADRA2B
SCHEMBL28319376 0.74 PDK1 (0.41) TNFKDM4DADRA1DADRA1AADRA2B
SCHEMBL29850460 0.72 LMNA (0.39) TNFMEN1KMT2A
SCHEMBL10851634 0.72 LMNA (0.39) TNFMEN1KMT2A
SCHEMBL17093931 0.72 LMNA (0.39) TNFMEN1KMT2A
SCHEMBL13764941 0.72 LMNA (0.39) TNFMEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110190300-A1 AMIDE COMPOUNDS AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2011-08-04 US disclosed
EP-2164326-A1 AMIDE COMPOUNDS AND THE USE THEREOF Euro-Celtique, S.A. (LU) 2010-03-24 EP disclosed
WO-2008150447-A1 AMIDE COMPOUNDS AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2008-12-11 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110190300-A1 AMIDE COMPOUNDS AND THE USE THEREOF CACNA1E, CACNA1B, CACNA1S TNF 3052/4885GRM5 701/4885MEN1 3484/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.